methyl 1-(4-fluorophenyl)carbonyl-2,4-diphenyl-5-(prop-2-enylcarbamoyl)pyrrolidine-3-carboxylate

Systemtic Name: methyl 1-(4-fluorophenyl)carbonyl-2,4-diphenyl-5-(prop-2-enylcarbamoyl)pyrrolidine-3-carboxylate Openeye Name: methyl 5-(allylcarbamoyl)-1-(4-fluorobenzoyl)-2,4-diphenyl-pyrrolidine-3-carboxylate CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-5-[oxo-(prop-2-enylamino)methyl]-2,4-diphenyl-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-fluorobenzoyl)-2,4-diphenyl-5-(prop-2-enylcarbamoyl)pyrrolidine-3-carboxylate Traditional Name: 5-(allylcarbamoyl)-1-(4-fluorobenzoyl)-2,4-diphenyl-pyrrolidine-3-carboxylic acid methyl ester Formula: C29H27FN2O4 MolecularWeight: 486.534083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C(N(C1C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)F)C(=O)NCC=C)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1C(C(N(C1C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)F)C(=O)NCC=C)C4=CC=CC=C4

InChI

InChI=1S/C29H27FN2O4/c1-3-18-31-27(33)26-23(19-10-6-4-7-11-19)24(29(35)36-2)25(20-12-8-5-9-13-20)32(26)28(34)21-14-16-22(30)17-15-21/h3-17,23-26H,1,18H2,2H3,(H,31,33)